Structure 9000354

9000353 << 9000354 >> 9000355
Original COD entry Download CIF Download DOT

Citation: Smyth, J. R. (1973). An orthopyroxene structure up to 850 C T = 175 C note temperature factors for O1b appear incorrect. American Mineralogist, 58, pp. 636-648.

Formula: Ca0.032 Fe1.332 Mg0.635 O6 Si2

Cell parameters:

  • a = 18.364 Å
  • b = 8.988 Å
  • c = 5.238 Å
  • α = 90°
  • β = 90°
  • γ = 90°

List type: noninterleaving

List: 3D

Combined 3D structure and graph

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JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 1

Basis: (1;0;0 0;1;0 0;0;1)

Dimensionality: 3

Formula: Ca8 Fe16 Mg16 O48 Si16 (Ca Fe2 Mg2 O6 Si2)

Multiplicity: 1

Coordination sequences:

  • 2, 6, 21, 43, 77, 123, 194, 223, 310, 410
  • 2, 8, 23, 49, 86, 109, 175, 235, 302, 411
  • 3, 8, 19, 46, 78, 119, 158, 242, 293, 396
  • 4, 12, 28, 58, 93, 154, 192, 273, 345, 436
  • 5, 9, 23, 47, 80, 124, 169, 255, 290, 407
  • 5, 11, 24, 56, 91, 126, 195, 247, 336, 394
  • 5, 13, 33, 52, 91, 143, 187, 277, 314, 422
  • 5, 13, 33, 67, 86, 149, 192, 266, 347, 420
  • 5, 21, 35, 54, 104, 148, 211, 261, 345, 430
  • 6, 13, 31, 62, 104, 139, 205, 274, 351, 427
  • 6, 17, 31, 54, 102, 147, 209, 265, 346, 427
  • 8, 14, 36, 67, 100, 142, 211, 275, 347, 428
  • 8, 19, 35, 65, 99, 160, 207, 286, 329, 443
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